N-[(Z)-1-phenylethylideneamino]-2-(4-propylphenoxy)acetamide

C19H22N2O2 — CID 6008008

IUPACN-[(Z)-1-phenylethylideneamino]-2-(4-propylphenoxy)acetamide
SMILESCCCc1ccc(OCC(=O)N/N=C(/C)c2ccccc2)cc1
InChIInChI=1S/C19H22N2O2/c1-3-7-16-10-12-18(13-11-16)23-14-19(22)21-20-15(2)17-8-5-4-6-9-17/h4-6,8-13H,3,7,14H2,1-2H3,(H,21,22)/b20-15-
InChIKeyMWMQRJXVUGGLQC-HKWRFOASSA-N
MW310.40 g/mol
LogP3.56
Rot. Bonds7

About N-[(Z)-1-phenylethylideneamino]-2-(4-propylphenoxy)acetamide

N-[(Z)-1-phenylethylideneamino]-2-(4-propylphenoxy)acetamide (PubChem CID 6008008) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-[(Z)-1-phenylethylideneamino]-2-(4-propylphenoxy)acetamide.

Molecular Properties

Compound NameN-[(Z)-1-phenylethylideneamino]-2-(4-propylphenoxy)acetamide
PubChem CID6008008
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC NameN-[(Z)-1-phenylethylideneamino]-2-(4-propylphenoxy)acetamide
SMILESCCCc1ccc(OCC(=O)N/N=C(/C)c2ccccc2)cc1
InChIInChI=1S/C19H22N2O2/c1-3-7-16-10-12-18(13-11-16)23-14-19(22)21-20-15(2)17-8-5-4-6-9-17/h4-6,8-13H,3,7,14H2,1-2H3,(H,21,22)/b20-15-
InChIKeyMWMQRJXVUGGLQC-HKWRFOASSA-N
XLogP3.56
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(4-ethylphenoxy)-N-(1-phenylethylideneamino)acetamide
CID 905266
2-phenoxy-N-(1-phenylethylideneamino)acetamide
CID 3448907
2-(4-cyanophenoxy)-N-[(Z)-1-(4-propylphenyl)ethylideneamino]acetamide
CID 9316565
2-(4-iodophenoxy)-N-[(Z)-1-phenylethylideneamino]acetamide
CID 171980951
2-phenyl-N-[(E)-1-(4-propylphenyl)ethylideneamino]acetamide
CID 6262359
2-(3,4-dimethylphenoxy)-N-(1-phenylethylideneamino)acetamide
CID 71950740
N,N'-bis[1-(4-propylphenyl)ethylideneamino]butanediamide
CID 4173019
N-[(E)-1-(3-methylphenyl)ethylideneamino]-2-phenoxyacetamide
CID 19685184
N-[(2-hydroxyphenyl)methylideneamino]-2-(4-propylphenoxy)acetamide
CID 3684670
2-(4-cyanophenoxy)-N-[(Z)-1-(4-ethylphenyl)ethylideneamino]acetamide
CID 9316462
N-[(Z)-1-(4-ethoxyphenyl)ethylideneamino]-2-phenylacetamide
CID 5399435
2-phenoxy-N-(1-phenylbutylideneamino)acetamide
CID 4504104

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-1-phenylethylideneamino]-2-(4-propylphenoxy)acetamide?
The IUPAC name of N-[(Z)-1-phenylethylideneamino]-2-(4-propylphenoxy)acetamide (CID 6008008) is N-[(Z)-1-phenylethylideneamino]-2-(4-propylphenoxy)acetamide.
What is the SMILES notation for N-[(Z)-1-phenylethylideneamino]-2-(4-propylphenoxy)acetamide?
The canonical SMILES for N-[(Z)-1-phenylethylideneamino]-2-(4-propylphenoxy)acetamide is CCCc1ccc(OCC(=O)N/N=C(/C)c2ccccc2)cc1.
What is the InChIKey of N-[(Z)-1-phenylethylideneamino]-2-(4-propylphenoxy)acetamide?
The InChIKey is MWMQRJXVUGGLQC-HKWRFOASSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-3-7-16-10-12-18(13-11-16)23-14-19(22)21-20-15(2)17-8-5-4-6-9-17/h4-6,8-13H,3,7,14H2,1-2H3,(H,21,22)/b20-15-.
What are the key properties of N-[(Z)-1-phenylethylideneamino]-2-(4-propylphenoxy)acetamide?
N-[(Z)-1-phenylethylideneamino]-2-(4-propylphenoxy)acetamide has a molecular weight of 310.40 g/mol, XLogP of 3.56, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-1-phenylethylideneamino]-2-(4-propylphenoxy)acetamide is sourced from PubChem (CID 6008008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).